4-[2-(3-Aminophenyl)pyrazolo[1,5-a]pyridin-3-yl]-N-(4-chloro-3-{[2-(1-pyrrolidinyl)ethyl]oxy}phenyl)-2-pyrimidinamine

HCID 57737228

Basic information

Standard SMILES
Nc1cccc(-c2nn3ccccc3c2-c2ccnc(Nc3ccc(Cl)c(OCCN4CCCC4)c3)n2)c1
InChIKey
LXXNXRFPUVGHPH-UHFFFAOYSA-N
Molecular formula
C29H28ClN7O
Average molar mass
526 g/mol

Names & identifiers

Preferred name
4-[2-(3-Aminophenyl)pyrazolo[1,5-a]pyridin-3-yl]-N-(4-chloro-3-{[2-(1-pyrrolidinyl)ethyl]oxy}phenyl)-2-pyrimidinamine
IUPAC
4-[2-(3-aminophenyl)pyrazolo[1,5-a]pyridin-3-yl]-N-[4-chloro-3-(2-pyrrolidin-1-ylethoxy)phenyl]pyrimidin-2-amine

Names & synonyms

SCHEMBL3537746LXXNXRFPUVGHPH-UHFFFAOYSA-N4-[2-(3-Aminophenyl)pyrazolo[1,5-a]pyridin-3-yl]-N-(4-chloro-3-{[2-(1-pyrrolidinyl)ethyl]oxy}phenyl)-2-pyrimidinamine

Database identifiers

PubChem CID
57737228

Properties

Computed structural properties

XLogP
5
Topological polar surface area
93.6 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
7
Rotatable bonds
8
Heavy atoms
38

Related reactions

3 records

Compound notes

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